N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-nitrophenyl)sulfonyl-prop-2-enyl-amino]butanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-nitrophenyl)sulfonyl-prop-2-enyl-amino]butanamide Openeye Name: 2-[allyl-(2-nitrophenyl)sulfonyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-nitrophenyl)sulfonyl-prop-2-enylamino]butanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2-nitrophenyl)sulfonyl-prop-2-enylamino]butanamide Traditional Name: 2-[allyl-(2-nitrophenyl)sulfonyl-amino]-N-homoveratryl-butyramide Formula: C23H29N3O7S MolecularWeight: 491.55726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N(CC=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N(CC=C)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O7S/c1-5-15-25(34(30,31)22-10-8-7-9-19(22)26(28)29)18(6-2)23(27)24-14-13-17-11-12-20(32-3)21(16-17)33-4/h5,7-12,16,18H,1,6,13-15H2,2-4H3,(H,24,27)