6-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonyl-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: 6-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]carbonyl-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Openeye Name: 6-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one CAS Name: 6-[[(2R)-2-(4-methoxyphenyl)-1-azepanyl]-oxomethyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one IUPAC Name: 6-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Traditional Name: 6-[(2R)-2-(4-methoxyphenyl)azepane-1-carbonyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCCCN2C(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4

InChI

InChI=1S/C25H27N3O3/c1-31-19-11-8-17(9-12-19)22-6-3-2-4-14-27(22)24(29)18-10-13-20-21(16-18)26-23-7-5-15-28(23)25(20)30/h8-13,16,22H,2-7,14-15H2,1H3/t22-/m1/s1