methyl 4-[[4-[(4-nitro-3-phenylmethoxy-phenyl)carbonylamino]-3-propoxy-phenyl]carbonylamino]-3-propan-2-yloxy-benzoate

Systemtic Name: methyl 4-[[4-[(4-nitro-3-phenylmethoxy-phenyl)carbonylamino]-3-propoxy-phenyl]carbonylamino]-3-propan-2-yloxy-benzoate Openeye Name: methyl 4-[[4-[(3-benzyloxy-4-nitro-benzoyl)amino]-3-propoxy-benzoyl]amino]-3-isopropoxy-benzoate CAS Name: 4-[[[4-[[(4-nitro-3-phenylmethoxyphenyl)-oxomethyl]amino]-3-propoxyphenyl]-oxomethyl]amino]-3-propan-2-yloxybenzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(4-nitro-3-phenylmethoxybenzoyl)amino]-3-propoxybenzoyl]amino]-3-propan-2-yloxybenzoate Traditional Name: 4-[[4-[(3-benzoxy-4-nitro-benzoyl)amino]-3-propoxy-benzoyl]amino]-3-isopropoxy-benzoic acid methyl ester Formula: C35H35N3O9 MolecularWeight: 641.6671

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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)OC)OC(C)C)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C35H35N3O9/c1-5-17-45-30-18-24(33(39)37-28-15-12-26(35(41)44-4)20-31(28)47-22(2)3)11-14-27(30)36-34(40)25-13-16-29(38(42)43)32(19-25)46-21-23-9-7-6-8-10-23/h6-16,18-20,22H,5,17,21H2,1-4H3,(H,36,40)(H,37,39)