N-[(3-chlorophenyl)methyl]-4-(cyclopropylamino)-3-nitro-benzamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-(cyclopropylamino)-3-nitro-benzamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-(cyclopropylamino)-3-nitro-benzamide CAS Name: N-[(3-chlorophenyl)methyl]-4-(cyclopropylamino)-3-nitrobenzamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-(cyclopropylamino)-3-nitrobenzamide Traditional Name: N-(3-chlorobenzyl)-4-(cyclopropylamino)-3-nitro-benzamide Formula: C17H16ClN3O3 MolecularWeight: 345.78024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O3/c18-13-3-1-2-11(8-13)10-19-17(22)12-4-7-15(20-14-5-6-14)16(9-12)21(23)24/h1-4,7-9,14,20H,5-6,10H2,(H,19,22)