methyl 3-[4-[(4-butoxyphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoate

Systemtic Name: methyl 3-[4-[(4-butoxyphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoate Openeye Name: methyl 3-[4-[(4-butoxyphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoate CAS Name: 3-[4-[(4-butoxyphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(4-butoxyphenyl)methoxy]-3-(1H-indol-5-yl)phenyl]propanoate Traditional Name: 3-[4-(4-butoxybenzyl)oxy-3-(1H-indol-5-yl)phenyl]propionic acid methyl ester Formula: C29H31NO4 MolecularWeight: 457.56074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)COC2=C(C=C(C=C2)CCC(=O)OC)C3=CC4=C(C=C3)NC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)COC2=C(C=C(C=C2)CCC(=O)OC)C3=CC4=C(C=C3)NC=C4

InChI

InChI=1S/C29H31NO4/c1-3-4-17-33-25-10-5-22(6-11-25)20-34-28-13-7-21(8-14-29(31)32-2)18-26(28)23-9-12-27-24(19-23)15-16-30-27/h5-7,9-13,15-16,18-19,30H,3-4,8,14,17,20H2,1-2H3