N-[(3S)-5-(4-methylpiperazin-1-yl)-3,4-dihydro-2H-chromen-3-yl]-3-phenyl-benzamide

Systemtic Name: N-[(3S)-5-(4-methylpiperazin-1-yl)-3,4-dihydro-2H-chromen-3-yl]-3-phenyl-benzamide Openeye Name: N-[(3S)-5-(4-methylpiperazin-1-yl)chroman-3-yl]-3-phenyl-benzamide CAS Name: N-[(3S)-5-(4-methyl-1-piperazinyl)-3,4-dihydro-2H-1-benzopyran-3-yl]-3-phenylbenzamide IUPAC Name: N-[(3S)-5-(4-methylpiperazin-1-yl)-3,4-dihydro-2H-chromen-3-yl]-3-phenylbenzamide Traditional Name: N-[(3S)-5-(4-methylpiperazino)chroman-3-yl]-3-phenyl-benzamide Formula: C27H29N3O2 MolecularWeight: 427.53806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3CC(COC3=CC=C2)NC(=O)C4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=C3C[C@@H](COC3=CC=C2)NC(=O)C4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2/c1-29-13-15-30(16-14-29)25-11-6-12-26-24(25)18-23(19-32-26)28-27(31)22-10-5-9-21(17-22)20-7-3-2-4-8-20/h2-12,17,23H,13-16,18-19H2,1H3,(H,28,31)/t23-/m0/s1