3-[4-[4-(2-oxidanylidenechromen-7-yl)oxypiperidin-1-yl]butyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[4-[4-(2-oxidanylidenechromen-7-yl)oxypiperidin-1-yl]butyl]-1H-indole-5-carbonitrile Openeye Name: 3-[4-[4-(2-oxochromen-7-yl)oxy-1-piperidyl]butyl]-1H-indole-5-carbonitrile CAS Name: 3-[4-[4-[(2-oxo-1-benzopyran-7-yl)oxy]-1-piperidinyl]butyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[4-[4-(2-oxochromen-7-yl)oxypiperidin-1-yl]butyl]-1H-indole-5-carbonitrile Traditional Name: 3-[4-[4-(2-ketochromen-7-yl)oxypiperidino]butyl]-1H-indole-5-carbonitrile Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC3=C(C=C2)C=CC(=O)O3)CCCCC4=CNC5=C4C=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1OC2=CC3=C(C=C2)C=CC(=O)O3)CCCCC4=CNC5=C4C=C(C=C5)C#N

InChI

InChI=1S/C27H27N3O3/c28-17-19-4-8-25-24(15-19)21(18-29-25)3-1-2-12-30-13-10-22(11-14-30)32-23-7-5-20-6-9-27(31)33-26(20)16-23/h4-9,15-16,18,22,29H,1-3,10-14H2