methyl 2-[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitro-phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitro-phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitro-benzoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitrophenyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitrobenzoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[2-(3-methoxyphenyl)ethylamino]-5-nitro-benzoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C26H27N3O6 MolecularWeight: 477.50908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC(CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H27N3O6/c1-34-21-10-6-9-19(15-21)13-14-27-23-12-11-20(29(32)33)17-22(23)25(30)28-24(26(31)35-2)16-18-7-4-3-5-8-18/h3-12,15,17,24,27H,13-14,16H2,1-2H3,(H,28,30)