methyl 3-(ethylaminomethyl)-1-[2-(phenylmethyl)pentyl]indole-5-carboxylate

Systemtic Name: methyl 3-(ethylaminomethyl)-1-[2-(phenylmethyl)pentyl]indole-5-carboxylate Openeye Name: methyl 1-(2-benzylpentyl)-3-(ethylaminomethyl)indole-5-carboxylate CAS Name: 3-(ethylaminomethyl)-1-[2-(phenylmethyl)pentyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-benzylpentyl)-3-(ethylaminomethyl)indole-5-carboxylate Traditional Name: 1-(2-benzylpentyl)-3-(ethylaminomethyl)indole-5-carboxylic acid methyl ester Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNCC

Isomeric SMILES

CCCC(CC1=CC=CC=C1)CN2C=C(C3=C2C=CC(=C3)C(=O)OC)CNCC

InChI

InChI=1S/C25H32N2O2/c1-4-9-20(14-19-10-7-6-8-11-19)17-27-18-22(16-26-5-2)23-15-21(25(28)29-3)12-13-24(23)27/h6-8,10-13,15,18,20,26H,4-5,9,14,16-17H2,1-3H3