8-methyl-6-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-b][1,5]benzoxazepin-5-one

Systemtic Name: 8-methyl-6-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-b][1,5]benzoxazepin-5-one Openeye Name: 8-methyl-6-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-b][1,5]benzoxazepin-5-one CAS Name: 8-methyl-6-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-5-pyrido[2,3-b][1,5]benzoxazepinone IUPAC Name: 8-methyl-6-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]pyrido[2,3-b][1,5]benzoxazepin-5-one Traditional Name: 6-[3-keto-3-(4-phenylpiperazino)propyl]-8-methyl-pyrido[2,3-b][1,5]benzoxazepin-5-one Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=CC=N3)C(=O)N2CCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O3/c1-19-9-10-23-22(18-19)30(26(32)21-8-5-12-27-25(21)33-23)13-11-24(31)29-16-14-28(15-17-29)20-6-3-2-4-7-20/h2-10,12,18H,11,13-17H2,1H3