4-azanyl-N-[(2-chloranyl-6-methyl-phenyl)methyl]-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: 4-azanyl-N-[(2-chloranyl-6-methyl-phenyl)methyl]-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: 4-amino-N-[(2-chloro-6-methyl-phenyl)methyl]-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide CAS Name: 4-amino-N-[(2-chloro-6-methylphenyl)methyl]-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-amino-N-[(2-chloro-6-methylphenyl)methyl]-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: 4-amino-N-(2-chloro-6-methyl-benzyl)-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Formula: C31H35ClN4O5 MolecularWeight: 579.0864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)CNC(=O)C2CC(CN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4=C(C(=CC=C4)O)C)O)N

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)CNC(=O)C2CC(CN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4=C(C(=CC=C4)O)C)O)N

InChI

InChI=1S/C31H35ClN4O5/c1-18-8-6-12-24(32)23(18)16-34-30(40)26-15-21(33)17-36(26)31(41)28(38)25(14-20-9-4-3-5-10-20)35-29(39)22-11-7-13-27(37)19(22)2/h3-13,21,25-26,28,37-38H,14-17,33H2,1-2H3,(H,34,40)(H,35,39)