2-[(4-chloranylphenoxy)methyl]-5,6-dimethyl-3-(4-piperidin-4-ylbutyl)-3H-indole

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-5,6-dimethyl-3-(4-piperidin-4-ylbutyl)-3H-indole Openeye Name: 2-[(4-chlorophenoxy)methyl]-5,6-dimethyl-3-[4-(4-piperidyl)butyl]-3H-indole CAS Name: 2-[(4-chlorophenoxy)methyl]-5,6-dimethyl-3-[4-(4-piperidinyl)butyl]-3H-indole IUPAC Name: 2-[(4-chlorophenoxy)methyl]-5,6-dimethyl-3-(4-piperidin-4-ylbutyl)-3H-indole Traditional Name: 2-[(4-chlorophenoxy)methyl]-5,6-dimethyl-3-[4-(4-piperidyl)butyl]-3H-indole Formula: C26H33ClN2O MolecularWeight: 425.00602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(C(=N2)COC3=CC=C(C=C3)Cl)CCCCC4CCNCC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(C(=N2)COC3=CC=C(C=C3)Cl)CCCCC4CCNCC4)C

InChI

InChI=1S/C26H33ClN2O/c1-18-15-24-23(6-4-3-5-20-11-13-28-14-12-20)26(29-25(24)16-19(18)2)17-30-22-9-7-21(27)8-10-22/h7-10,15-16,20,23,28H,3-6,11-14,17H2,1-2H3