4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(3,4-diethoxyphenyl)-1H-indol-3-yl]butylamine Formula: C32H42N2O2 MolecularWeight: 486.68808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C45CC6CC(C4)CC(C6)C5)CCCCN)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)C45CC6CC(C4)CC(C6)C5)CCCCN)OCC

InChI

InChI=1S/C32H42N2O2/c1-3-35-29-11-8-24(16-30(29)36-4-2)31-26(7-5-6-12-33)27-17-25(9-10-28(27)34-31)32-18-21-13-22(19-32)15-23(14-21)20-32/h8-11,16-17,21-23,34H,3-7,12-15,18-20,33H2,1-2H3