N-[3-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[3-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[3-chloro-2-(4-ethyl-1-piperazinyl)phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[3-chloro-2-(4-ethylpiperazino)phenyl]-3-(3-nitrophenyl)acrylamide Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O3/c1-2-24-11-13-25(14-12-24)21-18(22)7-4-8-19(21)23-20(27)10-9-16-5-3-6-17(15-16)26(28)29/h3-10,15H,2,11-14H2,1H3,(H,23,27)