1-[(3S)-3-[bis(phenylmethyl)amino]-3,4-dihydro-2H-chromen-5-yl]-4-methyl-piperazine-2,6-dione

Systemtic Name: 1-[(3S)-3-[bis(phenylmethyl)amino]-3,4-dihydro-2H-chromen-5-yl]-4-methyl-piperazine-2,6-dione Openeye Name: 1-[(3S)-3-(dibenzylamino)chroman-5-yl]-4-methyl-piperazine-2,6-dione CAS Name: 1-[(3S)-3-[bis(phenylmethyl)amino]-3,4-dihydro-2H-1-benzopyran-5-yl]-4-methylpiperazine-2,6-dione IUPAC Name: 1-[(3S)-3-(dibenzylamino)-3,4-dihydro-2H-chromen-5-yl]-4-methylpiperazine-2,6-dione Traditional Name: 1-[(3S)-3-(dibenzylamino)chroman-5-yl]-4-methyl-piperazine-2,6-quinone Formula: C28H29N3O3 MolecularWeight: 455.54816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C(=O)C1)C2=C3CC(COC3=CC=C2)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CN1CC(=O)N(C(=O)C1)C2=C3C[C@@H](COC3=CC=C2)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c1-29-18-27(32)31(28(33)19-29)25-13-8-14-26-24(25)15-23(20-34-26)30(16-21-9-4-2-5-10-21)17-22-11-6-3-7-12-22/h2-14,23H,15-20H2,1H3/t23-/m0/s1