2-methoxyethyl-[(5S)-1-methyl-3-[(5-methylfuran-2-yl)methylcarbamoyl]-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: 2-methoxyethyl-[(5S)-1-methyl-3-[(5-methylfuran-2-yl)methylcarbamoyl]-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-methoxyethyl-[(5S)-1-methyl-3-[(5-methyl-2-furyl)methylcarbamoyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-methoxyethyl-[(5S)-1-methyl-3-[[(5-methyl-2-furanyl)methylamino]-oxomethyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2-methoxyethyl-[(5S)-1-methyl-3-[(5-methylfuran-2-yl)methylcarbamoyl]-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-methoxyethyl-[(5S)-1-methyl-3-[(5-methyl-2-furyl)methylcarbamoyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2=NN(C3=C2CC(CC3)[NH2+]CCOC)C

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)C2=NN(C3=C2C[C@H](CC3)[NH2+]CCOC)C

InChI

InChI=1S/C18H26N4O3/c1-12-4-6-14(25-12)11-20-18(23)17-15-10-13(19-8-9-24-3)5-7-16(15)22(2)21-17/h4,6,13,19H,5,7-11H2,1-3H3,(H,20,23)/p+1/t13-/m0/s1