butyl 2-[[3-[4-[(3-methoxyphenyl)methylcarbamoyl]piperidin-1-yl]-3-oxidanylidene-propyl]carbamoylamino]benzoate

Systemtic Name: butyl 2-[[3-[4-[(3-methoxyphenyl)methylcarbamoyl]piperidin-1-yl]-3-oxidanylidene-propyl]carbamoylamino]benzoate Openeye Name: butyl 2-[[3-[4-[(3-methoxyphenyl)methylcarbamoyl]-1-piperidyl]-3-oxo-propyl]carbamoylamino]benzoate CAS Name: 2-[[[[3-[4-[[(3-methoxyphenyl)methylamino]-oxomethyl]-1-piperidinyl]-3-oxopropyl]amino]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[3-[4-[(3-methoxyphenyl)methylcarbamoyl]piperidin-1-yl]-3-oxopropyl]carbamoylamino]benzoate Traditional Name: 2-[[3-keto-3-[4-(m-anisylcarbamoyl)piperidino]propyl]carbamoylamino]benzoic acid butyl ester Formula: C29H38N4O6 MolecularWeight: 538.63522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)NCCC(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)NCCC(=O)N2CCC(CC2)C(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C29H38N4O6/c1-3-4-18-39-28(36)24-10-5-6-11-25(24)32-29(37)30-15-12-26(34)33-16-13-22(14-17-33)27(35)31-20-21-8-7-9-23(19-21)38-2/h5-11,19,22H,3-4,12-18,20H2,1-2H3,(H,31,35)(H2,30,32,37)