2-azanyl-4-[2,5-dimethyl-3-[(4-methylpiperidin-1-yl)methyl]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[2,5-dimethyl-3-[(4-methylpiperidin-1-yl)methyl]phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[2,5-dimethyl-3-[(4-methyl-1-piperidyl)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[2,5-dimethyl-3-[(4-methyl-1-piperidinyl)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[2,5-dimethyl-3-[(4-methylpiperidin-1-yl)methyl]phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[2,5-dimethyl-3-[(4-methylpiperidino)methyl]phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=C(C(=CC(=C2)C)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)C

Isomeric SMILES

CC1CCN(CC1)CC2=C(C(=CC(=C2)C)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)C

InChI

InChI=1S/C27H35N3O2/c1-16-6-8-30(9-7-16)15-19-10-17(2)11-20(18(19)3)24-21(14-28)26(29)32-23-13-27(4,5)12-22(31)25(23)24/h10-11,16,24H,6-9,12-13,15,29H2,1-5H3