3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 3-[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4,8-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl]-7-hydroxy-4,8-dimethyl-chromen-2-one CAS Name: 3-[2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl]-7-hydroxy-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl]-7-hydroxy-4,8-dimethylchromen-2-one Traditional Name: 3-[2-(4-benzhydrylpiperazino)-2-keto-ethyl]-7-hydroxy-4,8-dimethyl-coumarin Formula: C30H30N2O4 MolecularWeight: 482.5702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H30N2O4/c1-20-24-13-14-26(33)21(2)29(24)36-30(35)25(20)19-27(34)31-15-17-32(18-16-31)28(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-14,28,33H,15-19H2,1-2H3