3-[[4-[[[3,5-bis(chloranyl)phenyl]carbamoyl-[4-(cyclohexen-1-yl)phenyl]amino]methyl]phenyl]carbonylamino]-2-methyl-propanoic acid

Systemtic Name: 3-[[4-[[[3,5-bis(chloranyl)phenyl]carbamoyl-[4-(cyclohexen-1-yl)phenyl]amino]methyl]phenyl]carbonylamino]-2-methyl-propanoic acid Openeye Name: 3-[[4-[[4-(cyclohexen-1-yl)-N-[(3,5-dichlorophenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-methyl-propanoic acid CAS Name: 3-[[[4-[[4-(1-cyclohexenyl)-N-[(3,5-dichloroanilino)-oxomethyl]anilino]methyl]phenyl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 3-[[4-[[4-(cyclohexen-1-yl)-N-[(3,5-dichlorophenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-methylpropanoic acid Traditional Name: 3-[[4-[[4-(cyclohexen-1-yl)-N-[(3,5-dichlorophenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-methyl-propionic acid Formula: C31H31Cl2N3O4 MolecularWeight: 580.50154

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C3=CCCCC3)C(=O)NC4=CC(=CC(=C4)Cl)Cl)C(=O)O

Isomeric SMILES

CC(CNC(=O)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C3=CCCCC3)C(=O)NC4=CC(=CC(=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C31H31Cl2N3O4/c1-20(30(38)39)18-34-29(37)24-9-7-21(8-10-24)19-36(31(40)35-27-16-25(32)15-26(33)17-27)28-13-11-23(12-14-28)22-5-3-2-4-6-22/h5,7-17,20H,2-4,6,18-19H2,1H3,(H,34,37)(H,35,40)(H,38,39)