ethyl 2-[[4-[4-(phenylmethyl)piperidin-1-yl]-3-(propan-2-ylcarbamoyl)phenyl]carbamoylamino]ethanoate

Systemtic Name: ethyl 2-[[4-[4-(phenylmethyl)piperidin-1-yl]-3-(propan-2-ylcarbamoyl)phenyl]carbamoylamino]ethanoate Openeye Name: ethyl 2-[[4-(4-benzyl-1-piperidyl)-3-(isopropylcarbamoyl)phenyl]carbamoylamino]acetate CAS Name: 2-[[oxo-[3-[oxo-(propan-2-ylamino)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]anilino]methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(4-benzylpiperidin-1-yl)-3-(propan-2-ylcarbamoyl)phenyl]carbamoylamino]acetate Traditional Name: 2-[[4-(4-benzylpiperidino)-3-(isopropylcarbamoyl)phenyl]carbamoylamino]acetic acid ethyl ester Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NC(C)C

Isomeric SMILES

CCOC(=O)CNC(=O)NC1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)C(=O)NC(C)C

InChI

InChI=1S/C27H36N4O4/c1-4-35-25(32)18-28-27(34)30-22-10-11-24(23(17-22)26(33)29-19(2)3)31-14-12-21(13-15-31)16-20-8-6-5-7-9-20/h5-11,17,19,21H,4,12-16,18H2,1-3H3,(H,29,33)(H2,28,30,34)