4-[[4-[(4-azanyl-3-phenylmethoxy-phenyl)carbonylamino]-3-propoxy-phenyl]carbonylamino]-3-propan-2-yloxy-benzoic acid

Systemtic Name: 4-[[4-[(4-azanyl-3-phenylmethoxy-phenyl)carbonylamino]-3-propoxy-phenyl]carbonylamino]-3-propan-2-yloxy-benzoic acid Openeye Name: 4-[[4-[(4-amino-3-benzyloxy-benzoyl)amino]-3-propoxy-benzoyl]amino]-3-isopropoxy-benzoic acid CAS Name: 4-[[[4-[[(4-amino-3-phenylmethoxyphenyl)-oxomethyl]amino]-3-propoxyphenyl]-oxomethyl]amino]-3-propan-2-yloxybenzoic acid IUPAC Name: 4-[[4-[(4-amino-3-phenylmethoxybenzoyl)amino]-3-propoxybenzoyl]amino]-3-propan-2-yloxybenzoic acid Traditional Name: 4-[[4-[(4-amino-3-benzoxy-benzoyl)amino]-3-propoxy-benzoyl]amino]-3-isopropoxy-benzoic acid Formula: C34H35N3O7 MolecularWeight: 597.6576

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)OC(C)C)NC(=O)C3=CC(=C(C=C3)N)OCC4=CC=CC=C4

Isomeric SMILES

CCCOC1=C(C=CC(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)OC(C)C)NC(=O)C3=CC(=C(C=C3)N)OCC4=CC=CC=C4

InChI

InChI=1S/C34H35N3O7/c1-4-16-42-30-18-24(33(39)37-28-15-12-25(34(40)41)19-31(28)44-21(2)3)11-14-27(30)36-32(38)23-10-13-26(35)29(17-23)43-20-22-8-6-5-7-9-22/h5-15,17-19,21H,4,16,20,35H2,1-3H3,(H,36,38)(H,37,39)(H,40,41)