(8S)-6-azanyl-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile

Systemtic Name: (8S)-6-azanyl-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Openeye Name: (8S)-6-amino-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile CAS Name: (8S)-6-amino-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile IUPAC Name: (8S)-6-amino-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Traditional Name: (8S)-6-amino-8-(4-phenylphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile Formula: C27H25N5 MolecularWeight: 419.5209

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1CC=C2C(C1)[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N5/c1-2-13-32-14-12-22-23(15-28)26(31)27(17-29,18-30)25(24(22)16-32)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h3-12,24-25H,2,13-14,16,31H2,1H3/t24?,25-/m1/s1