methyl 3-[1-(3-benzamidophenyl)ethyl-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[1-(3-benzamidophenyl)ethyl-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[1-(3-benzamidophenyl)ethyl-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[1-(3-benzamidophenyl)ethyl-methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[1-(3-benzamidophenyl)ethyl-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[1-(3-benzamidophenyl)ethyl-methyl-carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C25H23N3O6 MolecularWeight: 461.46662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O6/c1-16(18-10-7-11-21(13-18)26-23(29)17-8-5-4-6-9-17)27(2)24(30)19-12-20(25(31)34-3)15-22(14-19)28(32)33/h4-16H,1-3H3,(H,26,29)