3-nitro-4-[(phenylmethyl)amino]-N-propan-2-yl-benzamide

Systemtic Name: 3-nitro-4-[(phenylmethyl)amino]-N-propan-2-yl-benzamide Openeye Name: 4-(benzylamino)-N-isopropyl-3-nitro-benzamide CAS Name: 3-nitro-4-[(phenylmethyl)amino]-N-propan-2-ylbenzamide IUPAC Name: 4-(benzylamino)-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-(benzylamino)-N-isopropyl-3-nitro-benzamide Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-12(2)19-17(21)14-8-9-15(16(10-14)20(22)23)18-11-13-6-4-3-5-7-13/h3-10,12,18H,11H2,1-2H3,(H,19,21)