3-oxidanylidene-2-phenyl-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazine-6-carbonitrile

Systemtic Name: 3-oxidanylidene-2-phenyl-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazine-6-carbonitrile Openeye Name: 3-oxo-2-phenyl-4-[5-(1-piperidyl)pentyl]-1,4-benzoxazine-6-carbonitrile CAS Name: 3-oxo-2-phenyl-4-[5-(1-piperidinyl)pentyl]-1,4-benzoxazine-6-carbonitrile IUPAC Name: 3-oxo-2-phenyl-4-(5-piperidin-1-ylpentyl)-1,4-benzoxazine-6-carbonitrile Traditional Name: 3-keto-2-phenyl-4-(5-piperidinopentyl)-1,4-benzoxazine-6-carbonitrile Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCN2C3=C(C=CC(=C3)C#N)OC(C2=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCCCCN2C3=C(C=CC(=C3)C#N)OC(C2=O)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c26-19-20-12-13-23-22(18-20)28(17-9-3-8-16-27-14-6-2-7-15-27)25(29)24(30-23)21-10-4-1-5-11-21/h1,4-5,10-13,18,24H,2-3,6-9,14-17H2