[1-butyl-3-(2-dimethylaminoethyl)indol-4-yl] dihydrogen phosphate

Systemtic Name: [1-butyl-3-(2-dimethylaminoethyl)indol-4-yl] dihydrogen phosphate Openeye Name: [1-butyl-3-(2-dimethylaminoethyl)indol-4-yl] dihydrogen phosphate CAS Name: [1-butyl-3-(2-dimethylaminoethyl)-4-indolyl] dihydrogen phosphate IUPAC Name: [1-butyl-3-(2-dimethylaminoethyl)indol-4-yl] dihydrogen phosphate Traditional Name: [1-butyl-3-(2-dimethylaminoethyl)indol-4-yl] dihydrogen phosphate Formula: C16H25N2O4P MolecularWeight: 340.354461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=C1C=CC=C2OP(=O)(O)O)CCN(C)C

Isomeric SMILES

CCCCN1C=C(C2=C1C=CC=C2OP(=O)(O)O)CCN(C)C

InChI

InChI=1S/C16H25N2O4P/c1-4-5-10-18-12-13(9-11-17(2)3)16-14(18)7-6-8-15(16)22-23(19,20)21/h6-8,12H,4-5,9-11H2,1-3H3,(H2,19,20,21)