N-[2-[(2-nitrophenyl)amino]ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[2-(2-nitroanilino)ethyl]benzamide CAS Name: N-[2-(2-nitroanilino)ethyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[2-(2-nitroanilino)ethyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-[2-(2-nitroanilino)ethyl]benzamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O4/c1-14(2)24-20(27)23-13-15-7-9-16(10-8-15)19(26)22-12-11-21-17-5-3-4-6-18(17)25(28)29/h3-10,14,21H,11-13H2,1-2H3,(H,22,26)(H2,23,24,27)