1-[(2S)-2-[(2-bromophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-2-[(2-bromophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(2S)-2-[(2-bromophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(2S)-2-[[(2-bromoanilino)-oxomethyl]amino]-1-oxo-3-phenylpropyl]-N-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-2-[(2-bromophenyl)carbamoylamino]-3-phenylpropanoyl]-N-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-[(2S)-2-[(2-bromophenyl)carbamoylamino]-3-phenyl-propanoyl]-N-m-anisyl-isonipecotamide Formula: C30H33BrN4O4 MolecularWeight: 593.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)NC4=CC=CC=C4Br

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2CCN(CC2)C(=O)[C@H](CC3=CC=CC=C3)NC(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C30H33BrN4O4/c1-39-24-11-7-10-22(18-24)20-32-28(36)23-14-16-35(17-15-23)29(37)27(19-21-8-3-2-4-9-21)34-30(38)33-26-13-6-5-12-25(26)31/h2-13,18,23,27H,14-17,19-20H2,1H3,(H,32,36)(H2,33,34,38)/t27-/m0/s1