ethyl 3-[[2-[[2-(3,3-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-[2-[methyl(phenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]carbamoylamino]benzoate

Systemtic Name: ethyl 3-[[2-[[2-(3,3-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-[2-[methyl(phenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl]carbamoylamino]benzoate Openeye Name: ethyl 3-[[2-[N-[2-(3,3-dimethyl-1-piperidyl)-2-oxo-ethyl]-2-[methyl(phenyl)carbamoyl]anilino]-2-oxo-ethyl]carbamoylamino]benzoate CAS Name: 3-[[[[2-[N-[2-(3,3-dimethyl-1-piperidinyl)-2-oxoethyl]-2-[(N-methylanilino)-oxomethyl]anilino]-2-oxoethyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[N-[2-(3,3-dimethylpiperidin-1-yl)-2-oxoethyl]-2-[methyl(phenyl)carbamoyl]anilino]-2-oxoethyl]carbamoylamino]benzoate Traditional Name: 3-[[2-[N-[2-(3,3-dimethylpiperidino)-2-keto-ethyl]-2-[methyl(phenyl)carbamoyl]anilino]-2-keto-ethyl]carbamoylamino]benzoic acid ethyl ester Formula: C35H41N5O6 MolecularWeight: 627.72994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)N2CCCC(C2)(C)C)C3=CC=CC=C3C(=O)N(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)N2CCCC(C2)(C)C)C3=CC=CC=C3C(=O)N(C)C4=CC=CC=C4

InChI

InChI=1S/C35H41N5O6/c1-5-46-33(44)25-13-11-14-26(21-25)37-34(45)36-22-30(41)40(23-31(42)39-20-12-19-35(2,3)24-39)29-18-10-9-17-28(29)32(43)38(4)27-15-7-6-8-16-27/h6-11,13-18,21H,5,12,19-20,22-24H2,1-4H3,(H2,36,37,45)