9-methyl-6-phenylmethoxy-9-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]-1,2,3,4-tetrahydrocarbazol-9-ium-3-amine

Systemtic Name: 9-methyl-6-phenylmethoxy-9-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]-1,2,3,4-tetrahydrocarbazol-9-ium-3-amine Openeye Name: 6-benzyloxy-9-[2-(1-isopropylpyrazol-4-yl)ethyl]-9-methyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-amine CAS Name: 9-methyl-6-phenylmethoxy-9-[2-(1-propan-2-yl-4-pyrazolyl)ethyl]-1,2,3,4-tetrahydrocarbazol-9-ium-3-amine IUPAC Name: 9-methyl-6-phenylmethoxy-9-[2-(1-propan-2-ylpyrazol-4-yl)ethyl]-1,2,3,4-tetrahydrocarbazol-9-ium-3-amine Traditional Name: [6-benzoxy-9-[2-(1-isopropylpyrazol-4-yl)ethyl]-9-methyl-1,2,3,4-tetrahydrocarbazol-9-ium-3-yl]amine Formula: C28H35N4O+ MolecularWeight: 443.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=N1)CC[N+]2(C3=C(CC(CC3)N)C4=C2C=CC(=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC(C)N1C=C(C=N1)CC[N+]2(C3=C(CC(CC3)N)C4=C2C=CC(=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C28H35N4O/c1-20(2)31-18-22(17-30-31)13-14-32(3)27-11-9-23(29)15-25(27)26-16-24(10-12-28(26)32)33-19-21-7-5-4-6-8-21/h4-8,10,12,16-18,20,23H,9,11,13-15,19,29H2,1-3H3/q+1