6-[4-(azepan-1-ylcarbonyl)phenyl]-1'-methyl-spiro[3H-chromene-2,4'-piperidine]-4-one

Systemtic Name: 6-[4-(azepan-1-ylcarbonyl)phenyl]-1'-methyl-spiro[3H-chromene-2,4'-piperidine]-4-one Openeye Name: 6-[4-(azepane-1-carbonyl)phenyl]-1'-methyl-spiro[chromane-2,4'-piperidine]-4-one CAS Name: 6-[4-[1-azepanyl(oxo)methyl]phenyl]-1'-methyl-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidine]one IUPAC Name: 6-[4-(azepane-1-carbonyl)phenyl]-1'-methylspiro[3H-chromene-2,4'-piperidine]-4-one Traditional Name: 6-[4-(azepane-1-carbonyl)phenyl]-1'-methyl-spiro[chroman-2,4'-piperidine]-4-one Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCCCCC5

Isomeric SMILES

CN1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C(=O)N5CCCCCC5

InChI

InChI=1S/C27H32N2O3/c1-28-16-12-27(13-17-28)19-24(30)23-18-22(10-11-25(23)32-27)20-6-8-21(9-7-20)26(31)29-14-4-2-3-5-15-29/h6-11,18H,2-5,12-17,19H2,1H3