5-[(3-chloranyl-2-nitro-phenyl)carbonylamino]-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide

Systemtic Name: 5-[(3-chloranyl-2-nitro-phenyl)carbonylamino]-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide Openeye Name: 5-[(3-chloro-2-nitro-benzoyl)amino]-4-(diethylaminomethyl)-2-(o-tolyl)benzamide CAS Name: 5-[[(3-chloro-2-nitrophenyl)-oxomethyl]amino]-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide IUPAC Name: 5-[(3-chloro-2-nitrobenzoyl)amino]-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide Traditional Name: 5-[(3-chloro-2-nitro-benzoyl)amino]-4-(diethylaminomethyl)-2-(o-tolyl)benzamide Formula: C26H27ClN4O4 MolecularWeight: 494.96998

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=C(C(=C1)C2=CC=CC=C2C)C(=O)N)NC(=O)C3=C(C(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC1=C(C=C(C(=C1)C2=CC=CC=C2C)C(=O)N)NC(=O)C3=C(C(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C26H27ClN4O4/c1-4-30(5-2)15-17-13-20(18-10-7-6-9-16(18)3)21(25(28)32)14-23(17)29-26(33)19-11-8-12-22(27)24(19)31(34)35/h6-14H,4-5,15H2,1-3H3,(H2,28,32)(H,29,33)