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butanedioic acid; N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine

butanedioic acid; N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine

Systemtic Name:butanedioic acid; N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine
Openeye Name:N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine; succinic acid
CAS Name:butanedioic acid; N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine
IUPAC Name:butanedioic acid; N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine
Traditional Name:dimethyl-[2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethyl]amine; succinic acid
Formula: C19H25N5O4
MolecularWeight: 387.4329
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CNC2=C1C=C(C=C2)CN3C=NC=N3.C(CC(=O)O)C(=O)O


Isomeric SMILES

CN(C)CCC1=CNC2=C1C=C(C=C2)CN3C=NC=N3.C(CC(=O)O)C(=O)O


InChI

InChI=1S/C15H19N5.C4H6O4/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20;5-3(6)1-2-4(7)8/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3;1-2H2,(H,5,6)(H,7,8)


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