N-[2-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]ethyl]-2-methyl-propanamide

Systemtic Name: N-[2-[[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]amino]ethyl]-2-methyl-propanamide Openeye Name: N-[2-[[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]amino]ethyl]-2-methyl-propanamide CAS Name: N-[2-[[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]ethyl]-2-methylpropanamide IUPAC Name: N-[2-[[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]amino]ethyl]-2-methylpropanamide Traditional Name: N-[2-[[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]amino]ethyl]-2-methyl-propionamide Formula: C15H18ClN3O4 MolecularWeight: 339.77412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C=CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)/C=C/C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H18ClN3O4/c1-10(2)15(21)18-8-7-17-14(20)6-4-11-3-5-12(16)13(9-11)19(22)23/h3-6,9-10H,7-8H2,1-2H3,(H,17,20)(H,18,21)/b6-4+