methyl 6-azanyl-8-methoxy-2-[(2,2,6,6-tetraethylpiperidin-4-yl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylate

Systemtic Name: methyl 6-azanyl-8-methoxy-2-[(2,2,6,6-tetraethylpiperidin-4-yl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylate Openeye Name: methyl 6-amino-8-methoxy-2-[(2,2,6,6-tetraethyl-4-piperidyl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylate CAS Name: 6-amino-8-methoxy-2-[(2,2,6,6-tetraethyl-4-piperidinyl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-8-methoxy-2-[(2,2,6,6-tetraethylpiperidin-4-yl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylate Traditional Name: 6-amino-8-methoxy-2-[(2,2,6,6-tetraethyl-4-piperidyl)amino]-1,3,5-triazabicyclo[3.2.1]oct-2-ene-4-carboxylic acid methyl ester Formula: C21H40N6O3 MolecularWeight: 424.5807

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CC(N1)(CC)CC)NC2=NC(N3C(CN2C3OC)N)C(=O)OC)CC

Isomeric SMILES

CCC1(CC(CC(N1)(CC)CC)NC2=NC(N3C(CN2C3OC)N)C(=O)OC)CC

InChI

InChI=1S/C21H40N6O3/c1-7-20(8-2)11-14(12-21(9-3,10-4)25-20)23-18-24-16(17(28)29-5)27-15(22)13-26(18)19(27)30-6/h14-16,19,25H,7-13,22H2,1-6H3,(H,23,24)