1-chloranyl-2-(diphenylmethyl)-4-nitro-benzene; 2-(methylamino)ethyl benzoate

Systemtic Name: 1-chloranyl-2-(diphenylmethyl)-4-nitro-benzene; 2-(methylamino)ethyl benzoate Openeye Name: 2-benzhydryl-1-chloro-4-nitro-benzene; 2-(methylamino)ethyl benzoate CAS Name: benzoic acid 2-(methylamino)ethyl ester; 1-chloro-2-(diphenylmethyl)-4-nitrobenzene IUPAC Name: 2-benzhydryl-1-chloro-4-nitrobenzene; 2-(methylamino)ethyl benzoate Traditional Name: 2-benzhydryl-1-chloro-4-nitro-benzene; benzoic acid 2-(methylamino)ethyl ester Formula: C29H27ClN2O4 MolecularWeight: 502.98868

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Descriptors Computed from Structure

Canonical SMILES:

CNCCOC(=O)C1=CC=CC=C1.C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CNCCOC(=O)C1=CC=CC=C1.C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H14ClNO2.C10H13NO2/c20-18-12-11-16(21(22)23)13-17(18)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15;1-11-7-8-13-10(12)9-5-3-2-4-6-9/h1-13,19H;2-6,11H,7-8H2,1H3