1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-phenylazanyl-piperidine-4-carbonitrile

Systemtic Name: 1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-phenylazanyl-piperidine-4-carbonitrile Openeye Name: 1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-anilino-piperidine-4-carbonitrile CAS Name: 1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-anilino-4-piperidinecarbonitrile IUPAC Name: 1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-anilinopiperidine-4-carbonitrile Traditional Name: 1-[(1R,3aR)-2,3,3a,4,5,6-hexahydro-1H-phenalen-1-yl]-4-anilino-isonipecotonitrile Formula: C25H29N3 MolecularWeight: 371.51786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC(C3=CC=CC(=C23)C1)N4CCC(CC4)(C#N)NC5=CC=CC=C5

Isomeric SMILES

C1C[C@@H]2CC[C@H](C3=CC=CC(=C23)C1)N4CCC(CC4)(C#N)NC5=CC=CC=C5

InChI

InChI=1S/C25H29N3/c26-18-25(27-21-9-2-1-3-10-21)14-16-28(17-15-25)23-13-12-20-7-4-6-19-8-5-11-22(23)24(19)20/h1-3,5,8-11,20,23,27H,4,6-7,12-17H2/t20-,23-/m1/s1