3-[2-[2-(diethylazaniumyl)ethylamino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate

Systemtic Name: 3-[2-[2-(diethylazaniumyl)ethylamino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate Openeye Name: 3-[2-[2-(diethylammonio)ethylamino]-2-oxo-ethyl]-1-methyl-indole-2-carboxylate CAS Name: 3-[2-[2-(diethylammonio)ethylamino]-2-oxoethyl]-1-methyl-2-indolecarboxylate IUPAC Name: 3-[2-[2-(diethylazaniumyl)ethylamino]-2-oxoethyl]-1-methylindole-2-carboxylate Traditional Name: 3-[2-[2-(diethylammonio)ethylamino]-2-keto-ethyl]-1-methyl-indole-2-carboxylate Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)CC1=C(N(C2=CC=CC=C21)C)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCNC(=O)CC1=C(N(C2=CC=CC=C21)C)C(=O)[O-]

InChI

InChI=1S/C18H25N3O3/c1-4-21(5-2)11-10-19-16(22)12-14-13-8-6-7-9-15(13)20(3)17(14)18(23)24/h6-9H,4-5,10-12H2,1-3H3,(H,19,22)(H,23,24)