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

Systemtic Name: 2-[[4-[(E)-3-phenylprop-2-enoyl]phenyl]amino]-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-[4-[(E)-3-phenylprop-2-enoyl]anilino]-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[4-[(E)-1-oxo-3-phenylprop-2-enyl]anilino]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-[4-[(E)-3-phenylprop-2-enoyl]anilino]-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-[4-[(E)-3-phenylacryloyl]anilino]-3-piperidino-1,4-naphthoquinone Formula: C30H26N2O3 MolecularWeight: 462.53904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O3/c33-26(18-13-21-9-3-1-4-10-21)22-14-16-23(17-15-22)31-27-28(32-19-7-2-8-20-32)30(35)25-12-6-5-11-24(25)29(27)34/h1,3-6,9-18,31H,2,7-8,19-20H2/b18-13+