methyl 4-[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylcarbamoyl]benzoate

Systemtic Name: methyl 4-[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylcarbamoyl]benzoate Openeye Name: methyl 4-[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylcarbamoyl]benzoate CAS Name: 4-[[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylcarbamoyl]benzoate Traditional Name: 4-[3-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]prop-2-ynylcarbamoyl]benzoic acid methyl ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)C#CCNC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)C#CCNC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H25N3O3/c1-27(2)14-12-20-16-26-22-11-6-17(15-21(20)22)5-4-13-25-23(28)18-7-9-19(10-8-18)24(29)30-3/h6-11,15-16,26H,12-14H2,1-3H3,(H,25,28)