ethyl 3-[[2-(dimethylamino)-2-phenyl-ethyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[[2-(dimethylamino)-2-phenyl-ethyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[[2-(dimethylamino)-2-phenyl-ethyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-(dimethylamino)-2-phenylethyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(dimethylamino)-2-phenylethyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(dimethylamino)-2-phenyl-ethyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC(C2=CC=CC=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCC(C2=CC=CC=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5/c1-4-28-20(25)16-10-15(11-17(12-16)23(26)27)19(24)21-13-18(22(2)3)14-8-6-5-7-9-14/h5-12,18H,4,13H2,1-3H3,(H,21,24)