2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]azanium

Systemtic Name: 2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-pyrrolidin-3-yl]azanium Openeye Name: 2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-isopropyl-pyrrolidin-3-yl]ammonium CAS Name: 2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-yl-3-pyrrolidinyl]ammonium IUPAC Name: 2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-propan-2-ylpyrrolidin-3-yl]azanium Traditional Name: 2-adamantyl-[(3S,5S)-5-(ethylcarbamoyl)-1-isopropyl-pyrrolidin-3-yl]ammonium Formula: C20H36N3O+ MolecularWeight: 334.51934

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(CN1C(C)C)[NH2+]C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@@H](CN1C(C)C)[NH2+]C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C20H35N3O/c1-4-21-20(24)18-10-17(11-23(18)12(2)3)22-19-15-6-13-5-14(8-15)9-16(19)7-13/h12-19,22H,4-11H2,1-3H3,(H,21,24)/p+1/t13?,14?,15?,16?,17-,18-,19?/m0/s1