N-(4-azanyl-4-ethyl-hexyl)-4-nitro-N-(1-phenylethyl)benzamide

Systemtic Name: N-(4-azanyl-4-ethyl-hexyl)-4-nitro-N-(1-phenylethyl)benzamide Openeye Name: N-(4-amino-4-ethyl-hexyl)-4-nitro-N-(1-phenylethyl)benzamide CAS Name: N-(4-amino-4-ethylhexyl)-4-nitro-N-(1-phenylethyl)benzamide IUPAC Name: N-(4-amino-4-ethylhexyl)-4-nitro-N-(1-phenylethyl)benzamide Traditional Name: N-(4-amino-4-ethyl-hexyl)-4-nitro-N-(1-phenylethyl)benzamide Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCN(C(C)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCC(CC)(CCCN(C(C)C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C23H31N3O3/c1-4-23(24,5-2)16-9-17-25(18(3)19-10-7-6-8-11-19)22(27)20-12-14-21(15-13-20)26(28)29/h6-8,10-15,18H,4-5,9,16-17,24H2,1-3H3