[4-[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-methoxy-3-oxidanylidene-propyl]phenyl] 4-(2-phenylethanoylamino)piperidine-1-carboxylate

Systemtic Name: [4-[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-methoxy-3-oxidanylidene-propyl]phenyl] 4-(2-phenylethanoylamino)piperidine-1-carboxylate Openeye Name: [4-[2-[(2-amino-4-methyl-pentanoyl)amino]-3-methoxy-3-oxo-propyl]phenyl] 4-[(2-phenylacetyl)amino]piperidine-1-carboxylate CAS Name: 4-[(1-oxo-2-phenylethyl)amino]-1-piperidinecarboxylic acid [4-[2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-methoxy-3-oxopropyl]phenyl] ester IUPAC Name: [4-[2-[(2-amino-4-methylpentanoyl)amino]-3-methoxy-3-oxopropyl]phenyl] 4-[(2-phenylacetyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(2-phenylacetyl)amino]piperidine-1-carboxylic acid [4-[2-[(2-amino-4-methyl-pentanoyl)amino]-3-keto-3-methoxy-propyl]phenyl] ester Formula: C30H40N4O6 MolecularWeight: 552.6618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCC(CC2)NC(=O)CC3=CC=CC=C3)C(=O)OC)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OC(=O)N2CCC(CC2)NC(=O)CC3=CC=CC=C3)C(=O)OC)N

InChI

InChI=1S/C30H40N4O6/c1-20(2)17-25(31)28(36)33-26(29(37)39-3)18-22-9-11-24(12-10-22)40-30(38)34-15-13-23(14-16-34)32-27(35)19-21-7-5-4-6-8-21/h4-12,20,23,25-26H,13-19,31H2,1-3H3,(H,32,35)(H,33,36)