3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-phenyl-cinchoninic acid Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C=CCC2CN1CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CN2C=CCC2CN1CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C24H23N3O2/c28-24(29)22-19-10-4-5-11-21(19)25-23(17-7-2-1-3-8-17)20(22)16-26-13-14-27-12-6-9-18(27)15-26/h1-8,10-12,18H,9,13-16H2,(H,28,29)