[1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-methyl-4-nitro-benzoate

Systemtic Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-methyl-4-nitro-benzoate Openeye Name: [2-[(9-ethylcarbazol-3-yl)amino]-1-methyl-2-oxo-ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [1-[(9-ethyl-3-carbazolyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C(C)OC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])C)C4=CC=CC=C41

InChI

InChI=1S/C25H23N3O5/c1-4-27-22-8-6-5-7-19(22)20-14-18(10-12-23(20)27)26-24(29)16(3)33-25(30)17-9-11-21(28(31)32)15(2)13-17/h5-14,16H,4H2,1-3H3,(H,26,29)