1-[(2R)-3-azanyl-2-oxidanyl-propyl]-3-[1-(1,2-dihydroacenaphthylen-1-yl)-3,6-dihydro-2H-pyridin-4-yl]indole-5-carbonitrile

Systemtic Name: 1-[(2R)-3-azanyl-2-oxidanyl-propyl]-3-[1-(1,2-dihydroacenaphthylen-1-yl)-3,6-dihydro-2H-pyridin-4-yl]indole-5-carbonitrile Openeye Name: 1-[(2R)-3-amino-2-hydroxy-propyl]-3-[1-(1,2-dihydroacenaphthylen-1-yl)-3,6-dihydro-2H-pyridin-4-yl]indole-5-carbonitrile CAS Name: 1-[(2R)-3-amino-2-hydroxypropyl]-3-[1-(1,2-dihydroacenaphthylen-1-yl)-3,6-dihydro-2H-pyridin-4-yl]-5-indolecarbonitrile IUPAC Name: 1-[(2R)-3-amino-2-hydroxypropyl]-3-[1-(1,2-dihydroacenaphthylen-1-yl)-3,6-dihydro-2H-pyridin-4-yl]indole-5-carbonitrile Traditional Name: 3-(1-acenaphthen-1-yl-3,6-dihydro-2H-pyridin-4-yl)-1-[(2R)-3-amino-2-hydroxy-propyl]indole-5-carbonitrile Formula: C29H28N4O MolecularWeight: 448.55882

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CN(C3=C2C=C(C=C3)C#N)CC(CN)O)C4CC5=CC=CC6=C5C4=CC=C6

Isomeric SMILES

C1CN(CC=C1C2=CN(C3=C2C=C(C=C3)C#N)C[C@@H](CN)O)C4CC5=CC=CC6=C5C4=CC=C6

InChI

InChI=1S/C29H28N4O/c30-15-19-7-8-27-25(13-19)26(18-33(27)17-23(34)16-31)20-9-11-32(12-10-20)28-14-22-5-1-3-21-4-2-6-24(28)29(21)22/h1-9,13,18,23,28,34H,10-12,14,16-17,31H2/t23-,28?/m1/s1