methyl 3-[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)ethanoylamino]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)ethanoylamino]-5-methyl-1H-indole-2-carboxylate Openeye Name: methyl 3-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)-1-oxoethyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]-5-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C20H26N3O5+ MolecularWeight: 388.43754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CCC4(CC3)OCCO4)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=O)C[NH+]3CCC4(CC3)OCCO4)C(=O)OC

InChI

InChI=1S/C20H25N3O5/c1-13-3-4-15-14(11-13)17(18(21-15)19(25)26-2)22-16(24)12-23-7-5-20(6-8-23)27-9-10-28-20/h3-4,11,21H,5-10,12H2,1-2H3,(H,22,24)/p+1