4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[3-(diethylaminomethyl)phenyl]-3-nitro-benzamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O3/c1-3-24(4-2)14-15-6-5-7-18(12-15)23-21(26)16-8-11-19(22-17-9-10-17)20(13-16)25(27)28/h5-8,11-13,17,22H,3-4,9-10,14H2,1-2H3,(H,23,26)