ethyl 2-[1-[(E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: ethyl 2-[1-[(E)-3-[1-(1-naphthylsulfonyl)indol-3-yl]prop-2-enoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(E)-3-[1-(1-naphthalenylsulfonyl)-3-indolyl]-1-oxoprop-2-enyl]-3-oxo-2-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(E)-3-(1-naphthalen-1-ylsulfonylindol-3-yl)prop-2-enoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[(E)-3-[1-(1-naphthylsulfonyl)indol-3-yl]acryloyl]piperazin-2-yl]acetic acid ethyl ester Formula: C29H27N3O6S MolecularWeight: 545.60618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)NCCN1C(=O)C=CC2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)CC1C(=O)NCCN1C(=O)/C=C/C2=CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H27N3O6S/c1-2-38-28(34)18-25-29(35)30-16-17-31(25)27(33)15-14-21-19-32(24-12-6-5-10-22(21)24)39(36,37)26-13-7-9-20-8-3-4-11-23(20)26/h3-15,19,25H,2,16-18H2,1H3,(H,30,35)/b15-14+