4-[5-(1-adamantyl)-2-(8-ethoxy-2-methyl-quinolin-5-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-(1-adamantyl)-2-(8-ethoxy-2-methyl-quinolin-5-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(8-ethoxy-2-methyl-5-quinolyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(8-ethoxy-2-methyl-5-quinolinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(8-ethoxy-2-methylquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(8-ethoxy-2-methyl-5-quinolyl)-1H-indol-3-yl]butylamine Formula: C34H41N3O MolecularWeight: 507.70884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)C56CC7CC(C5)CC(C7)C6)CCCCN)C=CC(=N2)C

Isomeric SMILES

CCOC1=C2C(=C(C=C1)C3=C(C4=C(N3)C=CC(=C4)C56CC7CC(C5)CC(C7)C6)CCCCN)C=CC(=N2)C

InChI

InChI=1S/C34H41N3O/c1-3-38-31-12-10-27(28-9-7-21(2)36-33(28)31)32-26(6-4-5-13-35)29-17-25(8-11-30(29)37-32)34-18-22-14-23(19-34)16-24(15-22)20-34/h7-12,17,22-24,37H,3-6,13-16,18-20,35H2,1-2H3