N-[3-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-3-oxidanylidene-propyl]-3-methyl-benzamide

Systemtic Name: N-[3-[(2-chloranyl-5-nitro-phenyl)methyl-methyl-amino]-3-oxidanylidene-propyl]-3-methyl-benzamide Openeye Name: N-[3-[(2-chloro-5-nitro-phenyl)methyl-methyl-amino]-3-oxo-propyl]-3-methyl-benzamide CAS Name: N-[3-[(2-chloro-5-nitrophenyl)methyl-methylamino]-3-oxopropyl]-3-methylbenzamide IUPAC Name: N-[3-[(2-chloro-5-nitrophenyl)methyl-methylamino]-3-oxopropyl]-3-methylbenzamide Traditional Name: N-[3-[(2-chloro-5-nitro-benzyl)-methyl-amino]-3-keto-propyl]-3-methyl-benzamide Formula: C19H20ClN3O4 MolecularWeight: 389.8328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)N(C)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)N(C)CC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H20ClN3O4/c1-13-4-3-5-14(10-13)19(25)21-9-8-18(24)22(2)12-15-11-16(23(26)27)6-7-17(15)20/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,25)