2-[[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]amino]-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-[[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]anilino]-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[4-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]anilino]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]anilino]-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-[4-[(E)-3-(4-methoxyphenyl)acryloyl]anilino]-3-piperidino-1,4-naphthoquinone Formula: C31H28N2O4 MolecularWeight: 492.56502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)N5CCCCC5

InChI

InChI=1S/C31H28N2O4/c1-37-24-16-9-21(10-17-24)11-18-27(34)22-12-14-23(15-13-22)32-28-29(33-19-5-2-6-20-33)31(36)26-8-4-3-7-25(26)30(28)35/h3-4,7-18,32H,2,5-6,19-20H2,1H3/b18-11+