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

Systemtic Name: 4-[5-(1-adamantyl)-2-(8-methoxy-2-methyl-quinolin-5-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(8-methoxy-2-methyl-5-quinolyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(8-methoxy-2-methyl-5-quinolinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(8-methoxy-2-methylquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(8-methoxy-2-methyl-5-quinolyl)-1H-indol-3-yl]butylamine Formula: C33H39N3O MolecularWeight: 493.68226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2C=C1)C3=C(C4=C(N3)C=CC(=C4)C56CC7CC(C5)CC(C7)C6)CCCCN)OC

Isomeric SMILES

CC1=NC2=C(C=CC(=C2C=C1)C3=C(C4=C(N3)C=CC(=C4)C56CC7CC(C5)CC(C7)C6)CCCCN)OC

InChI

InChI=1S/C33H39N3O/c1-20-6-8-27-26(9-11-30(37-2)32(27)35-20)31-25(5-3-4-12-34)28-16-24(7-10-29(28)36-31)33-17-21-13-22(18-33)15-23(14-21)19-33/h6-11,16,21-23,36H,3-5,12-15,17-19,34H2,1-2H3