4-[[(2R)-2-[bis(prop-2-enyl)amino]-3-methyl-butyl]amino]-3-nitro-benzamide

Systemtic Name: 4-[[(2R)-2-[bis(prop-2-enyl)amino]-3-methyl-butyl]amino]-3-nitro-benzamide Openeye Name: 4-[[(2R)-2-(diallylamino)-3-methyl-butyl]amino]-3-nitro-benzamide CAS Name: 4-[[(2R)-2-[bis(prop-2-enyl)amino]-3-methylbutyl]amino]-3-nitrobenzamide IUPAC Name: 4-[[(2R)-2-[bis(prop-2-enyl)amino]-3-methylbutyl]amino]-3-nitrobenzamide Traditional Name: 4-[[(2R)-2-(diallylamino)-3-methyl-butyl]amino]-3-nitro-benzamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])N(CC=C)CC=C

Isomeric SMILES

CC(C)[C@H](CNC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])N(CC=C)CC=C

InChI

InChI=1S/C18H26N4O3/c1-5-9-21(10-6-2)17(13(3)4)12-20-15-8-7-14(18(19)23)11-16(15)22(24)25/h5-8,11,13,17,20H,1-2,9-10,12H2,3-4H3,(H2,19,23)/t17-/m0/s1