N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]quinoline-5-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]quinoline-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]quinoline-5-carboxamide CAS Name: N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]-5-quinolinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]quinoline-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-2-[3-(methylamino)propyl]quinoline-5-carboxamide Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1=NC2=CC=CC(=C2C=C1)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CNCCCC1=NC2=CC=CC(=C2C=C1)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3O/c1-26-9-3-4-20-7-8-21-22(5-2-6-23(21)28-20)24(29)27-16-25-13-17-10-18(14-25)12-19(11-17)15-25/h2,5-8,17-19,26H,3-4,9-16H2,1H3,(H,27,29)