4-[[1-[2-[4-[(2-bromophenyl)carbamoylamino]-3-methoxy-phenyl]ethanoyl]pyrrolidin-2-yl]methoxy]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[1-[2-[4-[(2-bromophenyl)carbamoylamino]-3-methoxy-phenyl]ethanoyl]pyrrolidin-2-yl]methoxy]cyclohexane-1-carboxylic acid Openeye Name: 4-[[1-[2-[4-[(2-bromophenyl)carbamoylamino]-3-methoxy-phenyl]acetyl]pyrrolidin-2-yl]methoxy]cyclohexanecarboxylic acid CAS Name: 4-[[1-[2-[4-[[(2-bromoanilino)-oxomethyl]amino]-3-methoxyphenyl]-1-oxoethyl]-2-pyrrolidinyl]methoxy]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[1-[2-[4-[(2-bromophenyl)carbamoylamino]-3-methoxyphenyl]acetyl]pyrrolidin-2-yl]methoxy]cyclohexane-1-carboxylic acid Traditional Name: 4-[[1-[2-[4-[(2-bromophenyl)carbamoylamino]-3-methoxy-phenyl]acetyl]pyrrolidin-2-yl]methoxy]cyclohexanecarboxylic acid Formula: C28H34BrN3O6 MolecularWeight: 588.49006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(=O)N2CCCC2COC3CCC(CC3)C(=O)O)NC(=O)NC4=CC=CC=C4Br

Isomeric SMILES

COC1=C(C=CC(=C1)CC(=O)N2CCCC2COC3CCC(CC3)C(=O)O)NC(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C28H34BrN3O6/c1-37-25-15-18(8-13-24(25)31-28(36)30-23-7-3-2-6-22(23)29)16-26(33)32-14-4-5-20(32)17-38-21-11-9-19(10-12-21)27(34)35/h2-3,6-8,13,15,19-21H,4-5,9-12,14,16-17H2,1H3,(H,34,35)(H2,30,31,36)